Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “Diffusion model”

Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 1,423 records · Page 79

Ensemble Grouping Strategies for Embedded Stochastic Collocation Methods Applied to Anisotropic Diffusion Problems

Previous work has demonstrated that propagating groups of samples, called ensembles, together through forward simulations can dramatically reduce the aggregate cost of sampling-based uncertainty propagation methods [E. Phipps, M. D'Elia, H. C. Edwards, M. Hoemmen, J. Hu, and S. Rajamanickam, SIAM J. Sci. Comput., 39 (2017), pp. C162--C193]. However, critical to the success of this approach when applied to challenging problems of scientific interest is the grouping of samples into ensembles to minimize the total computational work. For example, the total number of linear solver iterations for ensemble systems may be strongly influenced by which samples form the ensemble when applying iterative linear solvers to parameterized and stochastic linear systems. In this paper we explore sample grouping strategies for local adaptive stochastic collocation methods applied to PDEs with uncertain input data, in particular canonical anisotropic diffusion problems where the diffusion coefficient is modeled by truncated Karhunen--Loève expansions. Finally, we demonstrate that a measure of the total anisotropy of the diffusion coefficient is a good surrogate for the number of linear solver iterations for each sample and therefore provides a simple and effective metric for grouping samples.

97 MATHEMATICS AND COMPUTING↗

Planck 2013 results. XIV. Zodiacal emission

The Planck satellite provides a set of all-sky maps at nine frequencies from 30GHz to 857GHz. Planets, minor bodies, and diffuse interplanetary dust emission (IPD) are all observed. The IPD can be separated from Galactic and other emissions because Planck views a given point on the celestial sphere multiple times, through different columns of IPD. We use the Planck data to investigate the behaviour of zodiacal emission over the whole sky at sub-millimetre and millimetre wavelengths. We fit the Planck data to find the emissivities of the various components of the COBE zodiacal model-a diffuse cloud, three asteroidal dust bands, a circumsolar ring, and an Earth-trailing feature. The emissivity of the diffuse cloud decreases with increasing wavelength, as expected from earlier analyses. The emissivities of the dust bands, however, decrease less rapidly, indicating that the properties of the grains in the bands are different from those in the diffuse cloud. We fit the small amount of Galactic emission seen through the telescope's far sidelobes, and place limits on possible contamination of the cosmic microwave background (CMB) results from both zodiacal and far-sidelobe emission. When necessary, the results are used in the Planck pipeline to make maps with zodiacal emission and far sidelobes removed. We show that the zodiacal correction to the CMB maps is small compared to the Planck CMB temperature power spectrum and give a list of flux densities for small solar system bodies.

79 ASTRONOMY AND ASTROPHYSICS↗

FermI large area telescope third source catalog

We present the third Fermi Large Area Telescope (LAT) source catalog (3FGL) of sources in the 100 MeV–300 GeV range. Based on the first 4 yr of science data from the Fermi Gamma-ray Space Telescope mission, it is the deepest yet in this energy range. Relative to the Second Fermi LAT catalog, the 3FGL catalog incorporates twice as much data, as well as a number of analysis improvements, including improved calibrations at the event reconstruction level, an updated model for Galactic diffuse γ-ray emission, a refined procedure for source detection, and improved methods for associating LAT sources with potential counterparts at other wavelengths. The 3FGL catalog includes 3033 sources above 4σ significance, with source location regions, spectral properties, and monthly light curves for each. Of these, 78 are flagged as potentially being due to imperfections in the model for Galactic diffuse emission. Twenty-five sources are modeled explicitly as spatially extended, and overall 238 sources are considered as identified based on angular extent or correlated variability (periodic or otherwise) observed at other wavelengths. For 1010 sources we have not found plausible counterparts at other wavelengths. More than 1100 of the identified or associated sources are active galaxies of the blazar class; several other classes of non-blazar active galaxies are also represented in the 3FGL. Pulsars represent the largest Galactic source class. From source counts of Galactic sources we estimate that the contribution of unresolved sources to the Galactic diffuse emission is ∼3% at 1 GeV.

79 ASTRONOMY AND ASTROPHYSICS↗

Evaluation of a hybrid kinetics/mixing-controlled combustion model for turbulent premixed and diffusion combustion using KIVA-2

Two dimensional calculations were made of spark ignited premixed-charge combustion and direct injection stratified-charge combustion in gasoline fueled piston engines. Results are obtained using kinetic-controlled combustion submodel governed by a four-step global chemical reaction or a hybrid laminar kinetics/mixing-controlled combustion submodel that accounts for laminar kinetics and turbulent mixing effects. The numerical solutions are obtained by using KIVA-2 computer code which uses a kinetic-controlled combustion submodel governed by a four-step global chemical reaction (i.e., it assumes that the mixing time is smaller than the chemistry). A hybrid laminar/mixing-controlled combustion submodel was implemented into KIVA-2. In this model, chemical species approach their thermodynamics equilibrium with a rate that is a combination of the turbulent-mixing time and the chemical-kinetics time. The combination is formed in such a way that the longer of the two times has more influence on the conversion rate and the energy release. An additional element of the model is that the laminar-flame kinetics strongly influence the early flame development following ignition.

Nguyen, H. Lee↗

SECONDARY PRODUCTION AS THE ORIGIN OF THE COSMIC-RAY POSITRON EXCESS

The Alpha Magnetic Spectrometer has released high-precision data for cosmic rays, and has verified an excess of positrons relative to expectations from cosmic-ray interactions in the interstellar medium. An exciting and well-known possibility for the excess is production of electron–positron pairs by annihilating dark matter particles in the halo of the Galaxy. We have constructed a new scenario for the propagation of cosmic rays, based on the 2000 SMILI results and various other astrophysical observations and measurements in which the positron excess is due to secondary production. The scenario is studied from a simple heuristic perspective, and also within the constraints of a diffusion-reacceleration model using GALPROP. The conclusions of each approach agree with one another, showing that the scenario agrees well with the observed positron flux, without any need for dark matter or other exotic production mechanisms.

79 ASTRONOMY AND ASTROPHYSICS↗

Evaluation of a hybrid kinetics/mixing-controlled combustion model for turbulent premixed and diffusion combustion using KIVA-II

Two-dimensional calculations were made of spark ignited premixed-charge combustion and direct injection stratified-charge combustion in gasoline fueled piston engines. Results are obtained using kinetic-controlled combustion submodel governed by a four-step global chemical reaction or a hybrid laminar kinetics/mixing-controlled combustion submodel that accounts for laminar kinetics and turbulent mixing effects. The numerical solutions are obtained by using KIVA-2 computer code which uses a kinetic-controlled combustion submodel governed by a four-step global chemical reaction (i.e., it assumes that the mixing time is smaller than the chemistry). A hybrid laminar/mixing-controlled combustion submodel was implemented into KIVA-2. In this model, chemical species approach their thermodynamics equilibrium with a rate that is a combination of the turbulent-mixing time and the chemical-kinetics time. The combination is formed in such a way that the longer of the two times has more influence on the conversion rate and the energy release. An additional element of the model is that the laminar-flame kinetics strongly influence the early flame development following ignition.

Nguyen, H. Lee↗

New complex bismuth oxides in the Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5} system and their properties

Phase equilibria in the Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5} system have been investigated. The isothermal section of the system (650°) has been constructed. For the first time the existence of the pyrochlore structure solid solution, (Bi{sub 2−x}Ni{sub x})Ni{sub 2/3−y}Sb{sub 4/3+y}O{sub 7±δ}, x=0.1−0.35, y=0−0.1, and a new compound Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} of KSbO{sub 3} structure type have been discovered. The structures and properties of these compounds were studied by XRD, XAFS, diffuse reflection spectroscopy and magnetic methods. Rietveld refinement of synchrotron radiation-based powder XRD data for pyrochlore sample of 38.43Bi{sub 2}O{sub 3}–33.0NiO–28.57Sb{sub 2}O{sub 5} composition and Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} compound was performed. The best possible refinement of the positional parameters for both pyrochlore and Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} structures was achieved for disordered models. Magnetic, diffuse reflection and an X-ray absorption spectroscopy study confirmed that in both compounds nickel ions are mainly in a 2+ oxidation state. According to magnetic data, Bi{sub 1.84}Ni{sub 0.16}(Ni{sub 0.63}Sb{sub 1.37})O{sub 7} pyrochlore and Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} are overall paramagnetic in nature. - Graphical abstract: Isothermal section of the Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5} system at 650 °C in air and variation of magnetic susceptibility and inverse susceptibility with temperature for Bi{sub 1.84}Ni{sub 0.79}Sb{sub 1.37}O{sub 7} pyrochlore. - Highlights: • We have constructed the isothermal section of the system Bi{sub 2}O{sub 3}–NiO–Sb{sub 2}O{sub 5}. • The boundaries of pyrochlore structure solid solution have been determined. • New Bi{sub 3}Ni{sub 2/3}Sb{sub 7/3}O{sub 11} compound of KSbO{sub 3} structure type have been discovered. • The structures were studied by means of synchrotron X-ray diffraction and XAFS. • Magnetic measurements revealed that both compounds are paramagnetic at 2–350 K.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Diffusion instability in a bimodal disc

A simplified model of radial diffusion in a planetary disk with a bimodal size distribution is presented. The large particle component excites the small particles' dispersion velocity via gravitational scattering. The resulting small particle viscous stress goes through a maximum near optical depth = sq root 3. Such a stress profile promotes the development of high and low optical depth zones. The resulting ringlet appearance is due primarily to the distribution of small particles, which produce most of the optical depth but may constitute only a minor portion of system mass.

Ward, W. R.↗

Formation of Leading-Edge Pinholes in the Space Shuttle Wings Investigated

The space shuttle wing leading edge and nose cap are composed of a carbon/carbon composite that is protected by silicon carbide. The coefficient of thermal expansion mismatch leads to cracks in the silicon carbide. The outer coating of the silicon carbide is a sodium-silicate-based glass that becomes fluid at the shuttles high reentry temperatures and fills these cracks. Small pinholes roughly 0.1 mm in diameter have been observed on these materials after 12 or more flights. These pinholes have been investigated by researchers at the NASA Johnson Space Center, Rockwell International, the Boeing Company, Lockheed Martin Corporation, and the NASA Glenn Research Center at Lewis Field to determine the possible sources and the extent of damage. A typical pinhole is illustrated in the photomicrographs. These pinholes are found primarily on the wing leading edges and not on the nose cap, which is covered when the orbiter is on the launch pad. The pinholes are generally associated with a bead of zincrich glass. Examination of the orbiter and launch structure indicates that weathering paint on the launch structure leads to deposits of zinc-containing paint flakes on the wing leading edge. These may become embedded in the crevices of the wing leading edge and form the observed zinc-rich glass. Laboratory experiments indicate that zinc oxide reacts vigorously with the glass coating on the silicon carbide. Thus, it is likely that this is the reaction that leads to pinhole formation (Christensen, S.V.: Reinforced Carbon/Carbon Pin Hole Formation Through Zinc Oxide Attack. Rockwell International Internal Letter, RDW 96 057, May 1996). Cross-sectional examination of pinholes suggests that they are enlarged thermal expansion mismatch cracks. This is illustrated in the photomicrographs. A careful microstructural analysis indicates that the pinhole walls consist of layers of zinc-containing glass. Thus, pinholes are likely formed by zinc oxide particles lodging in crevices and forming a corrosive zinc-rich glass that enlarges existing cracks. Having established the likely source of the pinholes, we next needed to model the damage. Our concern was that if a pinhole went through the silicon carbide to the carbon/carbon substrate, oxygen would have a clear path to oxidize the carbon at high temperatures. This possibility was examined with studies in a laboratory furnace. An ultrasonic drill was used to make artificial pinholes in a sample of protected carbon/carbon. After exposure, the specimens were weighed and cross-sectioned to quantify the extent of oxidation below the pinhole. The results at higher temperatures showed good agreement with a simple diffusion-control model. This model is based on the two-step oxidation of carbon to carbon monoxide and carbon dioxide. The fluxes are illustrated in the final figure. The model indicates a strong dependence on pinhole diameter. For smaller diameters and short times, the oxidation of carbon is very limited.

Jacobson, Nathan S.↗

Evaluation of turbulence models in the PARC code for transonic diffuser flows

Flows through a transonic diffuser were investigated with the PARC code using five turbulence models to determine the effects of turbulence model selection on flow prediction. Three of the turbulence models were algebraic models: Thomas (the standard algebraic turbulence model in PARC), Baldwin-Lomax, and Modified Mixing Length-Thomas (MMLT). The other two models were the low Reynolds number k-epsilon models of Chien and Speziale. Three diffuser flows, referred to as the no-shock, weak-shock, and strong-shock cases, were calculated with each model to conduct the evaluation. Pressure distributions, velocity profiles, locations of shocks, and maximum Mach numbers in the duct were the flow quantities compared. Overall, the Chien k-epsilon model was the most accurate of the five models when considering results obtained for all three cases. However, the MMLT model provided solutions as accurate as the Chien model for the no-shock and the weak-shock cases, at a substantially lower computational cost (measured in CPU time required to obtain converged solutions). The strong shock flow, which included a region of shock-induced flow separation, was only predicted well by the two k-epsilon models.

Georgiadis, N. J.↗

Mechanism for Surface Warming in the Equatorial Pacific during 1994-95

Mechanisms controlling the variation in sea surface temperature warm event in the equatorial Pacific were investigated through ocean model simulations. In addition, the mechanisms of the climatological SST cycle were investigated. The dominant mechanisms governing the seasonal cycle of SST vary significantly across the basin. In the western Pacific the annual cycle of SST is primarily in response to external heat flux. In the central basin the magnitude of zonal advection is comparable to that of the external heat flux. In the eastern basin the role of zonal advection is reduced and the vertical mixing is more important. In the easternmost equatorial Pacific the vertical entrainment contribution is as large as that of vertical diffusion. The model estimate of the vertical mixing contribution to the mixed layer heat budget compared well with estimates obtained by analysis of observations using the same diagnostic vertical mixing scheme. During 1994- 1995 the largest positive SST anomaly was observed in the mid-basin and was related to reduced latent heat flux due to weak surface winds. In the western basin the initial warming was related to enhanced external heating and reduced cooling effects of both vertical mixing and horizontal advection associated with weaker than usual wind stress. In the eastern Pacific where winds were not significantly anomalous throughout 1994-1995, only a moderate warm surface anomaly was detected. This is in contrast to strong El Nino events where the SST anomaly is largest in the eastern basin and, as shown by previous studies, the anomaly is due to zonal advection rather than anomalous surface heat flux. The end of the warm event was marked by cooling in July 1995 everywhere across the equatorial Pacific.

Rienecker, Michele M.↗

Effects of Electric and Magnetic Fields on the Spin Current in Organic Spintronic Devices

Organic semiconductors are suitable for spin transport because of the extremely long spin-diffusion length, which stems from the weak spin-orbit coupling. In this article, the drift-diffusion transport model to evaluate the spin current in a ferromagnetic/organic semiconductor structure is studied. Effects of the spin-dependent interfacial conductance, temperature and the polarization of the FM bulk on the spin current are discussed in the existence of the electric and magnetic fields. It is obtained that the electric and magnetic fields increase the spin current significantly.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

GenAI4UQ: A software for forward and inverse uncertainty quantification using conditional generative AI

We introduce GenAI4UQ, a software package for forward and inverse uncertainty quantification in model calibration, parameter estimation, and ensemble forecasting. GenAI4UQ leverages a generative AI-based conditional modeling framework to address limitations of traditional inverse modeling techniques, such as Markov Chain Monte Carlo (MCMC) methods. By replacing computationally intensive iterative processes with a direct, learned mapping, GenAI4UQ enables efficient calibration of input parameters and generation of predictions directly from observations. The software supports rapid ensemble forecasting with robust uncertainty quantification while maintaining computational and storage efficiency. Built-in auto-tuning of hyperparameters simplifies model training, ensuring accessibility for users with varying expertise. Its versatile conditional generative framework is applicable across diverse scientific domains. While GenAI4UQ offers significant advantages in flexibility and efficiency, users should interpret its uncertainty estimates with caution in data-sparse scenarios, as the model may overestimate uncertainty—an effect common to all surrogate-based approaches including MCMC with surrogate models. Despite this, GenAI4UQ transforms inverse modeling by providing a fast, reliable, and user-friendly solution. It empowers researchers and practitioners to quickly estimate parameter distributions and generate model predictions for new observations, facilitating efficient decision-making and advancing the state of uncertainty quantification in computational modeling.

97 MATHEMATICS AND COMPUTING↗

A finite difference informed random walker (FDiRW) solver for strongly inhomogeneous diffusion problems

In nature, many complex multi-physics coupling problems exhibit strong diffusivity inhomogeneity. For instance, in the context of radionuclide absorption by porous wasteform materials within a flowing waste stream, the difference of species’ diffusivity in solid and liquid phases spans by 3~8 orders of magnitude. To solve the diffusion equations with strongly inhomogeneous diffusivity, traditional discretization-based methods, such as the Finite Difference Method (FDM), require infinitesimally small time steps (<10 -10 ) as high spatial resolutions are employed in most microstructure evolution processes, leading to prohibitively high computational costs. Here, this work developed an integrated numerical approach (FDiRW: Finite Difference informed Random Walk) to tackle this challenge. The idea is that utilizing the Random Walk concept, the fast diffusion is modeled as a superposition of point source’s solution for a concentration distribution while FDM is used to obtain the point source’s solution at each node. A mesh-coarsening algorithm is developed to generate an exclusive coarse mesh for FDiRW approach to maximize its efficiency. The effectiveness of the coarse mesh-based FDiRW approach is validated by benchmarking Finite Difference solutions. Numerical results demonstrated that FDiRW achieves a remarkable 1000x computational efficiency improvement over FDM while preserving desired accuracy for a medium-sized model of 192 × 192 × 192 grids. Finally, as models scale up, a floating-point operations (PLOPs) analysis of the FDiRW algorithm reveals that its computational complexity grows quadratically in terms of the number of nodes employed in computation.

36 MATERIALS SCIENCE↗

A unified framework for polycrystal plasticity with grain boundary evolution

Plastic deformation in polycrystals is governed by the interplay between intra-granular slip and grain boundary-mediated plasticity. However, while the role played by bulk dislocations is relatively well-understood, the contribution of grain boundaries (GBs) has only recently begun to be studied. GB plasticity is known to play a key role along with bulk plasticity under a wide range of conditions, such as dynamic recovery, superplasticity, severe plastic deformation, etc., and developing models capable of simultaneously capturing GB and bulk plasticity has become a topic of high relevance. In this paper we develop a thermodynamically-consistent polycrystal plasticity model capable of simulating a variety of grain boundary-mediated plastic processes in conjunction with bulk dislocation slip. The model starts from the description of a single crystal and creates lattice strain-free polycrystalline configurations by using a specially-designed multiplicative decomposition developed by the authors. This leads to the introduction of a particular class of geometrically necessary dislocations (GND) that define fundamental GB features such as misorientation and inclination. The evolution of the system is based on an energy functional that uses a non-standard function of the GND tensor to account for the grain boundary energy, as well as for the standard elastic energy. Our implementation builds on smooth descriptions of GBs inspired on diffuse-interface models of grain evolution for numerical convenience. Here we demonstrate the generality and potential of the methodology by simulating a wide variety of phenomena such as shear-induced GB sliding, coupled GB motion, curvature-induced grain rotation and shrinkage, and polygonization via dislocation sub-grain formation.

36 MATERIALS SCIENCE↗

A generalized behavioral model for rotating short period comets with spectral orbital elements and axial orientation

A generalized model for short period comets is developed which integrates in a fairly rigorous manner the isolation history of regions on rotating comets with specified axial orientation and the complex feedback processes involving heat, gas and dust transport, dust mantle development and coma opacity. Attention is focused on development, reconfiguration and partial or complete launching of dust mantles and the reciprocal effects of these three processes on ice surface temperature and gas and dust production. The dust mantle controls the H2O flux not only by its effect on the temperature at the ice interface but (dominantly) by its dynamic stability which strongly influences vapor diffusivity. The model includes the effects of latitude, rotation and spin axis orientation are included and applied to an initially homogeneous sphere of H2O ice and silicate using the orbital parameters of comet Encke. Numerous variations of the model, using combinations of grain size distribution, dust-to-ice ratio, latitude and spin axis orientation, are presented and discussed. Resulted for a similar nonrotating, constant Sun orientation models are also included.

Fanale, F. P.↗

A Finite-Element Approach for the Partitioning of Carbon in Q&P Steel

This paper reports a Galerkin finite-element analysis of carbon partitioning from martensite into austenite during the quenching and partitioning (Q&P) processes in steels. In contrast to classical or sophisticated diffusion field models, an alternative nonlinear governing equation based on chemical potential and composition is considered. The model is applied to simulate the carbon partitioning of modified 22MnB5 alloys assuming an immobile austenite–martensite phase boundary and, in turn, is compared with experimental measurements of the volume fraction and carbon content of retained austenite. The simulations show outstanding results on the influence of Si and C content on the partitioning parameters.

36 MATERIALS SCIENCE↗

Landscape Evolution, A Comparison of Form and Process

This project's goals were to collect, analyze and interpret 3-dimensional physiographic data for understanding the processes responsible for landscape modification. The primary landforms to be studied were Neogene cinder cones in Arizona (San Francisco Volcanic Field (SFVF), Coconino and Kaibab National Forests, Arizona). We also obtained and are still analyzing digital topographic data for the Long Valley-White Mountains area of California, which display Quaternary normal fault scarps, as well as extensive evidence of degradation. The work resulted in a large database of measured rates of downslope transport of slope debris. It was hypothesized that the work would increase our understanding of process-response models of hillslope degradation, and of the effects of climate change and other parameters on degradation rates. In greater detail, our primary goal was to compare evolutionary sequences of hillslopes, as exemplified by the topography of landforms of the same type but of different ages, with measurements of the surficial processes active on the landforms. Assuming that other parameters, such as hillslope materials and vegetation are held constant, and that the effects of changing climate are negligible, then the sediment transport rates measured today on the landforms should be the same as those calculated from the inversion of landform topography by use of a diffusion-type model. However, if the effects of changing climate or other factors are not negligible, then the observed transport rates would differ from those which must be invoked to explain the current topography. We hypothesized in fact that because degradation on the event scale is highly transient and localized, we would find a wide divergence between modern, measured transport rates, and rates calculated by global landform inversion or modeling. Because of the length of time involved in collection of sufficient data on current degradation rates, we are still continuing to analyse and interpret the data. Completion of the work will increase our understanding of the potential effects of anthropogenic climate and surficial change on the Earth's solid surface, and possibly allow us to constrain paths of hill-slope evolution following anthropogenic modifications, as well as compare the short-term with the long-term rates of hillslope degradation.

Bursik, Marcus I.↗